methyl 4-nitro-3-(2,4,6-trimethylphenyl)sulfonyloxy-benzoate

Systemtic Name: methyl 4-nitro-3-(2,4,6-trimethylphenyl)sulfonyloxy-benzoate Openeye Name: methyl 4-nitro-3-(2,4,6-trimethylphenyl)sulfonyloxy-benzoate CAS Name: 4-nitro-3-(2,4,6-trimethylphenyl)sulfonyloxybenzoic acid methyl ester IUPAC Name: methyl 4-nitro-3-(2,4,6-trimethylphenyl)sulfonyloxybenzoate Traditional Name: 3-mesitylsulfonyloxy-4-nitro-benzoic acid methyl ester Formula: C17H17NO7S MolecularWeight: 379.38438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)OC2=C(C=CC(=C2)C(=O)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)OC2=C(C=CC(=C2)C(=O)OC)[N+](=O)[O-])C

InChI

InChI=1S/C17H17NO7S/c1-10-7-11(2)16(12(3)8-10)26(22,23)25-15-9-13(17(19)24-4)5-6-14(15)18(20)21/h5-9H,1-4H3